Geometry & MOs

Info

ID:	122483
PubChem CID:	50808778
Reduced:	ClS2N3O5C21H26 (1)
Stoich.:	AB2C3D5E21F26 (1)
Weight, g/mol:	434.143092
ΔH_f, kcal/mol:	-180.42
Dipole, Da:	4.99
IP(EA), eV:	-8.67(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-chlorophenyl)methylsulfonyl]-N-(2-propan-2-ylphenyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC(=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=CC=CC=C3Cl)S(=O)(=O)C

DOS

IR

Vibrations